cadmium(2+);bis(2,3-dihydroxypropanoate)

C6H10CdO8 — CID 175584526

IUPACcadmium(2+);bis(2,3-dihydroxypropanoate)
SMILESO=C([O-])C(O)CO.O=C([O-])C(O)CO.[Cd+2]
InChIInChI=1S/2C3H6O4.Cd/c2*4-1-2(5)3(6)7;/h2*2,4-5H,1H2,(H,6,7);/q;;+2/p-2
InChIKeyJWYDPTLHRKLLDP-UHFFFAOYSA-L
MW322.55 g/mol
LogP-5.82
Rot. Bonds4

About cadmium(2+);bis(2,3-dihydroxypropanoate)

cadmium(2+);bis(2,3-dihydroxypropanoate) (PubChem CID 175584526) has the molecular formula C6H10CdO8 and a molecular weight of 322.55 g/mol. Its IUPAC name is cadmium(2+);bis(2,3-dihydroxypropanoate).

Molecular Properties

Compound Namecadmium(2+);bis(2,3-dihydroxypropanoate)
PubChem CID175584526
Molecular FormulaC6H10CdO8
Molecular Weight322.55 g/mol
Exact Mass323.94
IUPAC Namecadmium(2+);bis(2,3-dihydroxypropanoate)
SMILESO=C([O-])C(O)CO.O=C([O-])C(O)CO.[Cd+2]
InChIInChI=1S/2C3H6O4.Cd/c2*4-1-2(5)3(6)7;/h2*2,4-5H,1H2,(H,6,7);/q;;+2/p-2
InChIKeyJWYDPTLHRKLLDP-UHFFFAOYSA-L
XLogP-5.82
TPSA161.18 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.55
LogP ≤ 5-5.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Related Compounds

2,3-dihydroxypropanoate triacetate
CID 22325987
copper;2,3-dihydroxypropanoate;sulfate
CID 158883106
cadmium(2+);2-hydroxybutanedioate
CID 87607349
(4S)-1,2,4,5-tetrahydroxypentan-3-one
CID 54455604
lithium 3-fluoro-2-hydroxypropanoate
CID 167714302
2,3-dihydroxypropanoic acid
CID 175601105
disodium;(2S)-2-hydroxybutanedioate
CID 6097189
tris(2-hydroxybutanedioate);bis(yttrium(3+))
CID 173103435
(2R,3S)-2,3,4-trihydroxybutanoate
CID 162224671
disilver;2-hydroxybutanedioate
CID 14299093
tris(2-hydroxybutanedioate);bis(terbium(3+))
CID 173160363
4-(1,3-dihydroxypropan-2-yloxy)-2-hydroxy-4-oxobutanoate
CID 18612380

Frequently Asked Questions

What is the IUPAC name of cadmium(2+);bis(2,3-dihydroxypropanoate)?
The IUPAC name of cadmium(2+);bis(2,3-dihydroxypropanoate) (CID 175584526) is cadmium(2+);bis(2,3-dihydroxypropanoate).
What is the SMILES notation for cadmium(2+);bis(2,3-dihydroxypropanoate)?
The canonical SMILES for cadmium(2+);bis(2,3-dihydroxypropanoate) is O=C([O-])C(O)CO.O=C([O-])C(O)CO.[Cd+2].
What is the InChIKey of cadmium(2+);bis(2,3-dihydroxypropanoate)?
The InChIKey is JWYDPTLHRKLLDP-UHFFFAOYSA-L. The full InChI is InChI=1S/2C3H6O4.Cd/c2*4-1-2(5)3(6)7;/h2*2,4-5H,1H2,(H,6,7);/q;;+2/p-2.
What are the key properties of cadmium(2+);bis(2,3-dihydroxypropanoate)?
cadmium(2+);bis(2,3-dihydroxypropanoate) has a molecular weight of 322.55 g/mol, XLogP of -5.82, 4 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for cadmium(2+);bis(2,3-dihydroxypropanoate) is sourced from PubChem (CID 175584526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).